1-[7-methyl-4-[[4-(trifluoromethyloxy)phenyl]amino]pyrrolo[2,3-d]pyrimidin-6-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[7-methyl-4-[[4-(trifluoromethyloxy)phenyl]amino]pyrrolo[2,3-d]pyrimidin-6-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[7-methyl-4-[4-(trifluoromethoxy)anilino]pyrrolo[2,3-d]pyrimidine-6-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[7-methyl-4-[4-(trifluoromethoxy)anilino]-6-pyrrolo[2,3-d]pyrimidinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[7-methyl-4-[4-(trifluoromethoxy)anilino]pyrrolo[2,3-d]pyrimidine-6-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[7-methyl-4-[4-(trifluoromethoxy)anilino]pyrrolo[2,3-d]pyrimidine-6-carbonyl]isonipecotamide Formula: C21H21F3N6O3 MolecularWeight: 462.42505

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1N=CN=C2NC3=CC=C(C=C3)OC(F)(F)F)C(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CN1C(=CC2=C1N=CN=C2NC3=CC=C(C=C3)OC(F)(F)F)C(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C21H21F3N6O3/c1-29-16(20(32)30-8-6-12(7-9-30)17(25)31)10-15-18(26-11-27-19(15)29)28-13-2-4-14(5-3-13)33-21(22,23)24/h2-5,10-12H,6-9H2,1H3,(H2,25,31)(H,26,27,28)